NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9613 8.2127 109.7401 45.3143 0.0000 173.3607 2 I 3.1037 8.2305 117.6978 63.3163 37.4894 173.1095 3 V 3.5106 7.5367 119.0344 65.8289 31.6387 176.7504 4 E 4.2247 7.9534 114.1956 57.8579 30.1304 178.2555 5 Q 4.1154 8.1989 119.9958 59.1877 28.8268 176.9866 6 C 4.7312 8.4046 115.6168 56.9087 40.7058 173.9612 7 C 4.4948 8.1116 117.5996 59.6402 28.8122 174.3675 8 T 4.3869 7.7795 109.5933 62.4087 69.6202 174.8420 9 S 4.6578 7.4973 114.3768 56.2582 66.1788 172.9671 10 I 4.1929 8.1830 122.8688 61.1369 37.4674 176.5433 11 C 4.7867 8.5960 123.5212 56.1940 35.5685 174.5305 12 S 4.5105 8.8960 119.6133 57.6207 65.4263 175.2800 13 L 4.0978 8.3947 120.4120 57.8410 40.9801 179.0916 14 Y 4.2858 7.9502 118.6532 60.9478 38.8838 177.4919 15 Q 3.8700 7.7450 117.5184 58.8047 28.6502 178.8032 16 L 4.1855 7.8178 119.7872 57.5978 41.6637 178.9246 17 E 3.9088 8.3670 119.3339 59.0655 29.2434 178.1987 18 N 4.1533 7.4799 115.8683 55.7626 38.8887 174.6391 19 Y 4.4351 7.7387 115.9309 57.8575 38.5042 175.6407 20 C 4.4386 7.7200 118.1751 59.6172 28.9256 173.5373 21 N 4.5406 8.5370 117.6603 53.7259 38.2811 175.4382 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 G 8.21 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 I 8.23 3.10 0.80 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.22 0.65 0.00 0.00 3 V 7.54 3.51 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.87 0.00 0.00 4 E 7.95 4.22 0.00 2.15 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.33 0.00 5 Q 8.20 4.12 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.87 0.00 0.00 0.00 0.00 0.00 2.59 2.65 0.00 6 C 8.40 4.73 0.00 2.90 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.11 4.49 0.00 3.13 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 T 7.78 4.39 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 9 S 7.50 4.66 0.00 4.08 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 I 8.18 4.19 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.81 0.92 0.00 0.00 11 C 8.60 4.79 0.00 2.98 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.90 4.51 0.00 4.11 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 8.39 4.10 0.00 1.78 1.82 0.95 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.95 4.29 0.00 2.90 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 Q 7.75 3.87 0.00 2.43 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 16 L 7.82 4.19 0.00 2.08 1.77 0.95 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.37 3.91 0.00 2.22 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.54 0.00 18 N 7.48 4.15 0.00 2.38 2.56 0.00 0.00 7.13 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 7.74 4.44 0.00 3.01 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 C 7.72 4.44 0.00 2.99 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.54 4.54 0.00 2.72 2.73 0.00 0.00 6.79 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00